5GMZ

Hepatitis B virus core protein Y132A mutant in complex with 4-methyl heteroaryldihydropyrimidine

Summary for 5GMZ

• Entry DOI: 10.2210/pdb5gmz/pdb
• Descriptor: Core protein, ISOPROPYL ALCOHOL, (2S)-4,4-difluoro-1-[[(4S)-4-(4-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-(1,3-thiazol-2-yl)-1H-pyrimidin-6-yl]methyl]pyrrolidine-2-carboxylic acid, ... (6 entities in total)
• Functional Keywords: hbv, capid assembly, hap, core protein, viral protein
• Biological source: Hepatitis B virus (HBV)
• Total number of polymer chains: 6
• Total formula weight: 109263.59

Authors

Xu, Z.H.,Zhou, Z. (deposition date: 2016-07-18, release date: 2016-08-10, Last modification date: 2023-11-08)

• Primary citation: Qiu, Z.,Lin, X.,Zhou, M.,Liu, Y.,Zhu, W.,Chen, W.,Zhang, W.,Guo, L.,Liu, H.,Wu, G.,Huang, M.,Jiang, M.,Xu, Z.,Zhou, Z.,Qin, N.,Ren, S.,Qiu, H.,Zhong, S.,Zhang, Y.,Zhang, Y.,Wu, X.,Shi, L.,Shen, F.,Mao, Y.,Zhou, X.,Yang, W.,Wu, J.Z.,Yang, G.,Mayweg, A.V.,Shen, H.C.,Tang, G.; Design and Synthesis of Orally Bioavailable 4-Methyl Heteroaryldihydropyrimidine Based Hepatitis B Virus (HBV) Capsid Inhibitors; J.Med.Chem., 59:7651-7666, 2016; PubMed: 27458651; DOI: 10.1021/acs.jmedchem.6b00879

Experimental method

X-RAY DIFFRACTION (1.7 Å)